%chk=000193125.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000193125

0 1
O 2.812686 2.456573 1.028580
O 2.987570 1.677557 -1.072561
O 3.515663 -2.666257 1.251846
O -3.728475 0.916864 1.997729
O -5.025782 -0.288041 -0.243907
N 0.242082 0.867804 -0.670166
N 3.619393 -3.414668 -0.879604
C 1.223908 0.806826 0.430924
C 1.699539 -0.618523 0.760180
C 2.336998 -1.357986 -0.418197
C -1.127915 0.756722 -0.449679
C 2.418896 1.661750 -0.006633
C 3.191335 -2.506476 0.088471
C -1.705159 0.713726 0.783748
C -1.962346 0.757880 -1.679748
C -3.149699 0.672394 0.968883
C -3.281376 0.551713 -1.606763
C -3.956756 0.259303 -0.301488
H 0.772384 1.263901 1.364428
H 2.421216 -0.579939 1.613281
H 0.840972 -1.207071 1.151644
H 1.553761 -1.724663 -1.110597
H 2.977658 -0.671445 -1.019737
H 0.617734 0.722864 -1.607459
H -1.131826 0.749999 1.708736
H -1.463564 0.952762 -2.632003
H -3.937181 0.554111 -2.480351
H 3.607652 3.022640 0.810803
H 3.421620 -3.325966 -1.857739
H 4.209911 -4.187855 -0.608918


%chk=000193125-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000193125

0 1
O 3.334450 2.188199 0.938014
O 2.592433 2.297963 -1.262565
O 3.832407 -2.398795 1.203775
O -3.569311 -0.375965 1.946364
O -5.132054 -0.191653 -0.426100
N 0.274898 1.043260 -0.650318
N 2.985700 -3.570082 -0.610321
C 1.281515 1.045042 0.414979
C 1.792112 -0.375290 0.818742
C 2.371702 -1.185762 -0.359738
C -1.054400 0.711985 -0.477995
C 2.443109 1.906954 -0.080950
C 3.119561 -2.426658 0.158001
C -1.615905 0.303588 0.731878
C -1.889512 0.827602 -1.693642
C -3.027749 -0.016445 0.850744
C -3.225073 0.540417 -1.681055
C -3.901045 0.091067 -0.436682
H 0.868637 1.526095 1.324832
H 2.568572 -0.264760 1.596029
H 0.953266 -0.932630 1.271945
H 1.577174 -1.465896 -1.075548
H 3.111220 -0.577009 -0.918949
H 0.600225 1.405600 -1.553838
H -1.024270 0.216060 1.647742
H -1.400405 1.159127 -2.619813
H -3.846288 0.627320 -2.579266
H 4.101726 2.722707 0.596508
H 2.390643 -3.604756 -1.435893
H 3.487559 -4.410786 -0.323179


